(2R)-N-(3-azanylpropyl)-2-[3-(6-methoxy-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)propanoylamino]-3-naphthalen-2-yl-propanamide

Systemtic Name: (2R)-N-(3-azanylpropyl)-2-[3-(6-methoxy-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)propanoylamino]-3-naphthalen-2-yl-propanamide Openeye Name: (2R)-N-(3-aminopropyl)-2-[3-(6-methoxy-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)propanoylamino]-3-(2-naphthyl)propanamide CAS Name: (2R)-N-(3-aminopropyl)-2-[[3-(6-methoxy-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)-1-oxopropyl]amino]-3-(2-naphthalenyl)propanamide IUPAC Name: (2R)-N-(3-aminopropyl)-2-[3-(6-methoxy-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)propanoylamino]-3-naphthalen-2-ylpropanamide Traditional Name: (2R)-N-(3-aminopropyl)-2-[3-(2-keto-6-methoxy-4,5-dihydro-3H-1-benzazepin-1-yl)propanoylamino]-3-(2-naphthyl)propionamide Formula: C30H36N4O4 MolecularWeight: 516.63124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1CCCC(=O)N2CCC(=O)NC(CC3=CC4=CC=CC=C4C=C3)C(=O)NCCCN

Isomeric SMILES

COC1=CC=CC2=C1CCCC(=O)N2CCC(=O)N[C@H](CC3=CC4=CC=CC=C4C=C3)C(=O)NCCCN

InChI

InChI=1S/C30H36N4O4/c1-38-27-11-5-10-26-24(27)9-4-12-29(36)34(26)18-15-28(35)33-25(30(37)32-17-6-16-31)20-21-13-14-22-7-2-3-8-23(22)19-21/h2-3,5,7-8,10-11,13-14,19,25H,4,6,9,12,15-18,20,31H2,1H3,(H,32,37)(H,33,35)/t25-/m1/s1