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

Systemtic Name: (2R)-2-[3-(3-acetamido-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)propanoylamino]-N-(2-azanylethyl)-3-naphthalen-2-yl-propanamide Openeye Name: (2R)-2-[3-(3-acetamido-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)propanoylamino]-N-(2-aminoethyl)-3-(2-naphthyl)propanamide CAS Name: (2R)-2-[[3-(3-acetamido-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)-1-oxopropyl]amino]-N-(2-aminoethyl)-3-(2-naphthalenyl)propanamide IUPAC Name: (2R)-2-[3-(3-acetamido-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)propanoylamino]-N-(2-aminoethyl)-3-naphthalen-2-ylpropanamide Traditional Name: (2R)-2-[3-(3-acetamido-2-keto-4,5-dihydro-3H-1-benzazepin-1-yl)propanoylamino]-N-(2-aminoethyl)-3-(2-naphthyl)propionamide Formula: C30H35N5O4 MolecularWeight: 529.63

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCC2=CC=CC=C2N(C1=O)CCC(=O)NC(CC3=CC4=CC=CC=C4C=C3)C(=O)NCCN

Isomeric SMILES

CC(=O)NC1CCC2=CC=CC=C2N(C1=O)CCC(=O)N[C@H](CC3=CC4=CC=CC=C4C=C3)C(=O)NCCN

InChI

InChI=1S/C30H35N5O4/c1-20(36)33-25-13-12-23-7-4-5-9-27(23)35(30(25)39)17-14-28(37)34-26(29(38)32-16-15-31)19-21-10-11-22-6-2-3-8-24(22)18-21/h2-11,18,25-26H,12-17,19,31H2,1H3,(H,32,38)(H,33,36)(H,34,37)/t25?,26-/m1/s1