2-[[(3-butoxy-3-oxidanylidene-propyl)-(2-methylpropyl)carbamoyl]amino]-3-naphthalen-2-yl-propanoic acid

Systemtic Name: 2-[[(3-butoxy-3-oxidanylidene-propyl)-(2-methylpropyl)carbamoyl]amino]-3-naphthalen-2-yl-propanoic acid Openeye Name: 2-[[(3-butoxy-3-oxo-propyl)-isobutyl-carbamoyl]amino]-3-(2-naphthyl)propanoic acid CAS Name: 2-[[[(3-butoxy-3-oxopropyl)-(2-methylpropyl)amino]-oxomethyl]amino]-3-(2-naphthalenyl)propanoic acid IUPAC Name: 2-[[(3-butoxy-3-oxopropyl)-(2-methylpropyl)carbamoyl]amino]-3-naphthalen-2-ylpropanoic acid Traditional Name: 2-[[(3-butoxy-3-keto-propyl)-isobutyl-carbamoyl]amino]-3-(2-naphthyl)propionic acid Formula: C25H34N2O5 MolecularWeight: 442.54786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCN(CC(C)C)C(=O)NC(CC1=CC2=CC=CC=C2C=C1)C(=O)O

Isomeric SMILES

CCCCOC(=O)CCN(CC(C)C)C(=O)NC(CC1=CC2=CC=CC=C2C=C1)C(=O)O

InChI

InChI=1S/C25H34N2O5/c1-4-5-14-32-23(28)12-13-27(17-18(2)3)25(31)26-22(24(29)30)16-19-10-11-20-8-6-7-9-21(20)15-19/h6-11,15,18,22H,4-5,12-14,16-17H2,1-3H3,(H,26,31)(H,29,30)