N-(aminomethyl)-3-naphthalen-2-yl-2-[2-(2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)ethanoylamino]propanamide

Systemtic Name: N-(aminomethyl)-3-naphthalen-2-yl-2-[2-(2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)ethanoylamino]propanamide Openeye Name: N-(aminomethyl)-3-(2-naphthyl)-2-[[2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetyl]amino]propanamide CAS Name: N-(aminomethyl)-3-(2-naphthalenyl)-2-[[1-oxo-2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)ethyl]amino]propanamide IUPAC Name: N-(aminomethyl)-3-naphthalen-2-yl-2-[[2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetyl]amino]propanamide Traditional Name: N-(aminomethyl)-2-[[2-(2-keto-4,5-dihydro-3H-1-benzazepin-1-yl)acetyl]amino]-3-(2-naphthyl)propionamide Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C(=O)C1)CC(=O)NC(CC3=CC4=CC=CC=C4C=C3)C(=O)NCN

Isomeric SMILES

C1CC2=CC=CC=C2N(C(=O)C1)CC(=O)NC(CC3=CC4=CC=CC=C4C=C3)C(=O)NCN

InChI

InChI=1S/C26H28N4O3/c27-17-28-26(33)22(15-18-12-13-19-6-1-2-8-21(19)14-18)29-24(31)16-30-23-10-4-3-7-20(23)9-5-11-25(30)32/h1-4,6-8,10,12-14,22H,5,9,11,15-17,27H2,(H,28,33)(H,29,31)