4-butoxy-N-[2-[methyl-[(1R)-1-(3-nitrophenyl)ethyl]amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 4-butoxy-N-[2-[methyl-[(1R)-1-(3-nitrophenyl)ethyl]amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-butoxy-N-[2-[methyl-[(1R)-1-(3-nitrophenyl)ethyl]amino]-2-oxo-ethyl]benzamide CAS Name: 4-butoxy-N-[2-[methyl-[(1R)-1-(3-nitrophenyl)ethyl]amino]-2-oxoethyl]benzamide IUPAC Name: 4-butoxy-N-[2-[methyl-[(1R)-1-(3-nitrophenyl)ethyl]amino]-2-oxoethyl]benzamide Traditional Name: 4-butoxy-N-[2-keto-2-[methyl-[(1R)-1-(3-nitrophenyl)ethyl]amino]ethyl]benzamide Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)N(C)C(C)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)N(C)[C@H](C)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O5/c1-4-5-13-30-20-11-9-17(10-12-20)22(27)23-15-21(26)24(3)16(2)18-7-6-8-19(14-18)25(28)29/h6-12,14,16H,4-5,13,15H2,1-3H3,(H,23,27)/t16-/m1/s1