methyl 4-[3-(dimethylamino)propylcarbamoyl]-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoate

Systemtic Name: methyl 4-[3-(dimethylamino)propylcarbamoyl]-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoate Openeye Name: methyl 4-[3-(dimethylamino)propylcarbamoyl]-2-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]benzoate CAS Name: 4-[[3-(dimethylamino)propylamino]-oxomethyl]-2-[[(Z)-3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(dimethylamino)propylcarbamoyl]-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoate Traditional Name: 4-[3-(dimethylamino)propylcarbamoyl]-2-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid methyl ester Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=C(C=CC(=C1)C(=O)NCCCN(C)C)C(=O)OC)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C/C(=C/C(=O)NC1=C(C=CC(=C1)C(=O)NCCCN(C)C)C(=O)OC)/C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C28H31N3O4/c1-19(21-11-10-20-8-5-6-9-22(20)17-21)16-26(32)30-25-18-23(12-13-24(25)28(34)35-4)27(33)29-14-7-15-31(2)3/h5-6,8-13,16-18H,7,14-15H2,1-4H3,(H,29,33)(H,30,32)/b19-16-