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

Systemtic Name: methyl 4-[(cyclopentylamino)methyl]-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoate Openeye Name: methyl 4-[(cyclopentylamino)methyl]-2-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]benzoate CAS Name: 4-[(cyclopentylamino)methyl]-2-[[(Z)-3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(cyclopentylamino)methyl]-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoate Traditional Name: 4-[(cyclopentylamino)methyl]-2-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid methyl ester Formula: C28H30N2O3 MolecularWeight: 442.5494

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=C(C=CC(=C1)CNC2CCCC2)C(=O)OC)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C/C(=C/C(=O)NC1=C(C=CC(=C1)CNC2CCCC2)C(=O)OC)/C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C28H30N2O3/c1-19(22-13-12-21-7-3-4-8-23(21)17-22)15-27(31)30-26-16-20(11-14-25(26)28(32)33-2)18-29-24-9-5-6-10-24/h3-4,7-8,11-17,24,29H,5-6,9-10,18H2,1-2H3,(H,30,31)/b19-15-