[nitro(phenyl)methyl] 2-[3-[[(E)-4-methoxy-4-oxidanylidene-but-2-en-2-yl]amino]-2-oxidanylidene-4-[(E)-2-phenylethenyl]azetidin-1-yl]-3-oxidanyl-butanoate

Systemtic Name: [nitro(phenyl)methyl] 2-[3-[[(E)-4-methoxy-4-oxidanylidene-but-2-en-2-yl]amino]-2-oxidanylidene-4-[(E)-2-phenylethenyl]azetidin-1-yl]-3-oxidanyl-butanoate Openeye Name: [nitro(phenyl)methyl] 3-hydroxy-2-[3-[[(E)-3-methoxy-1-methyl-3-oxo-prop-1-enyl]amino]-2-oxo-4-[(E)-styryl]azetidin-1-yl]butanoate CAS Name: 3-hydroxy-2-[3-[[(E)-4-methoxy-4-oxobut-2-en-2-yl]amino]-2-oxo-4-[(E)-2-phenylethenyl]-1-azetidinyl]butanoic acid [nitro(phenyl)methyl] ester IUPAC Name: [nitro(phenyl)methyl] 3-hydroxy-2-[3-[[(E)-4-methoxy-4-oxobut-2-en-2-yl]amino]-2-oxo-4-[(E)-2-phenylethenyl]azetidin-1-yl]butanoate Traditional Name: 3-hydroxy-2-[2-keto-3-[[(E)-3-keto-3-methoxy-1-methyl-prop-1-enyl]amino]-4-[(E)-styryl]azetidin-1-yl]butyric acid [nitro(phenyl)methyl] ester Formula: C27H29N3O8 MolecularWeight: 523.53446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OC(C1=CC=CC=C1)[N+](=O)[O-])N2C(C(C2=O)NC(=CC(=O)OC)C)C=CC3=CC=CC=C3)O

Isomeric SMILES

CC(C(C(=O)OC(C1=CC=CC=C1)[N+](=O)[O-])N2C(C(C2=O)N/C(=C/C(=O)OC)/C)/C=C/C3=CC=CC=C3)O

InChI

InChI=1S/C27H29N3O8/c1-17(16-22(32)37-3)28-23-21(15-14-19-10-6-4-7-11-19)29(25(23)33)24(18(2)31)27(34)38-26(30(35)36)20-12-8-5-9-13-20/h4-16,18,21,23-24,26,28,31H,1-3H3/b15-14+,17-16+