2-[[[2-(2-acetamidoethoxycarbonyl)-4-phenyl-butyl]-(2-methylpropyl)carbamoyl]amino]-3-naphthalen-2-yl-propanoic acid

Systemtic Name: 2-[[[2-(2-acetamidoethoxycarbonyl)-4-phenyl-butyl]-(2-methylpropyl)carbamoyl]amino]-3-naphthalen-2-yl-propanoic acid Openeye Name: 2-[[[2-(2-acetamidoethoxycarbonyl)-4-phenyl-butyl]-isobutyl-carbamoyl]amino]-3-(2-naphthyl)propanoic acid CAS Name: 2-[[[[2-[2-acetamidoethoxy(oxo)methyl]-4-phenylbutyl]-(2-methylpropyl)amino]-oxomethyl]amino]-3-(2-naphthalenyl)propanoic acid IUPAC Name: 2-[[[2-(2-acetamidoethoxycarbonyl)-4-phenylbutyl]-(2-methylpropyl)carbamoyl]amino]-3-naphthalen-2-ylpropanoic acid Traditional Name: 2-[[[2-(2-acetamidoethoxycarbonyl)-4-phenyl-butyl]-isobutyl-carbamoyl]amino]-3-(2-naphthyl)propionic acid Formula: C33H41N3O6 MolecularWeight: 575.69514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(CCC1=CC=CC=C1)C(=O)OCCNC(=O)C)C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)O

Isomeric SMILES

CC(C)CN(CC(CCC1=CC=CC=C1)C(=O)OCCNC(=O)C)C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)O

InChI

InChI=1S/C33H41N3O6/c1-23(2)21-36(22-29(16-13-25-9-5-4-6-10-25)32(40)42-18-17-34-24(3)37)33(41)35-30(31(38)39)20-26-14-15-27-11-7-8-12-28(27)19-26/h4-12,14-15,19,23,29-30H,13,16-18,20-22H2,1-3H3,(H,34,37)(H,35,41)(H,38,39)