3-[3,4-bis(phenylmethoxy)phenyl]-1-(4-chloranyl-3-nitro-phenyl)prop-2-en-1-one

Systemtic Name: 3-[3,4-bis(phenylmethoxy)phenyl]-1-(4-chloranyl-3-nitro-phenyl)prop-2-en-1-one Openeye Name: 1-(4-chloro-3-nitro-phenyl)-3-(3,4-dibenzyloxyphenyl)prop-2-en-1-one CAS Name: 3-[3,4-bis(phenylmethoxy)phenyl]-1-(4-chloro-3-nitrophenyl)-2-propen-1-one IUPAC Name: 3-[3,4-bis(phenylmethoxy)phenyl]-1-(4-chloro-3-nitrophenyl)prop-2-en-1-one Traditional Name: 1-(4-chloro-3-nitro-phenyl)-3-(3,4-dibenzoxyphenyl)prop-2-en-1-one Formula: C29H22ClNO5 MolecularWeight: 499.94168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=CC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=CC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])OCC4=CC=CC=C4

InChI

InChI=1S/C29H22ClNO5/c30-25-14-13-24(18-26(25)31(33)34)27(32)15-11-21-12-16-28(35-19-22-7-3-1-4-8-22)29(17-21)36-20-23-9-5-2-6-10-23/h1-18H,19-20H2