N-methyl-N-[(E,2R)-1-naphthalen-2-yl-5-oxidanylidene-5-[(2-oxidanylideneazepan-3-yl)amino]pent-3-en-2-yl]benzamide

Systemtic Name: N-methyl-N-[(E,2R)-1-naphthalen-2-yl-5-oxidanylidene-5-[(2-oxidanylideneazepan-3-yl)amino]pent-3-en-2-yl]benzamide Openeye Name: N-methyl-N-[(E,1R)-1-(2-naphthylmethyl)-4-oxo-4-[(2-oxoazepan-3-yl)amino]but-2-enyl]benzamide CAS Name: N-methyl-N-[(E,2R)-1-(2-naphthalenyl)-5-oxo-5-[(2-oxo-3-azepanyl)amino]pent-3-en-2-yl]benzamide IUPAC Name: N-methyl-N-[(E,2R)-1-naphthalen-2-yl-5-oxo-5-[(2-oxoazepan-3-yl)amino]pent-3-en-2-yl]benzamide Traditional Name: N-[(E,1R)-4-keto-4-[(2-ketoazepan-3-yl)amino]-1-(2-naphthylmethyl)but-2-enyl]-N-methyl-benzamide Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CC1=CC2=CC=CC=C2C=C1)C=CC(=O)NC3CCCCNC3=O)C(=O)C4=CC=CC=C4

Isomeric SMILES

CN([C@H](CC1=CC2=CC=CC=C2C=C1)/C=C/C(=O)NC3CCCCNC3=O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H31N3O3/c1-32(29(35)23-10-3-2-4-11-23)25(20-21-14-15-22-9-5-6-12-24(22)19-21)16-17-27(33)31-26-13-7-8-18-30-28(26)34/h2-6,9-12,14-17,19,25-26H,7-8,13,18,20H2,1H3,(H,30,34)(H,31,33)/b17-16+/t25-,26?/m0/s1