3-[2-[4-(naphthalen-1-ylcarbamoylamino)butanoylamino]ethanoylamino]-3-(4-phenylphenyl)propanoic acid

Systemtic Name: 3-[2-[4-(naphthalen-1-ylcarbamoylamino)butanoylamino]ethanoylamino]-3-(4-phenylphenyl)propanoic acid Openeye Name: 3-[[2-[4-(1-naphthylcarbamoylamino)butanoylamino]acetyl]amino]-3-(4-phenylphenyl)propanoic acid CAS Name: 3-[[2-[[4-[[(1-naphthalenylamino)-oxomethyl]amino]-1-oxobutyl]amino]-1-oxoethyl]amino]-3-(4-phenylphenyl)propanoic acid IUPAC Name: 3-[[2-[4-(naphthalen-1-ylcarbamoylamino)butanoylamino]acetyl]amino]-3-(4-phenylphenyl)propanoic acid Traditional Name: 3-[[2-[4-(1-naphthylcarbamoylamino)butanoylamino]acetyl]amino]-3-(4-phenylphenyl)propionic acid Formula: C32H32N4O5 MolecularWeight: 552.62028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(CC(=O)O)NC(=O)CNC(=O)CCCNC(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(CC(=O)O)NC(=O)CNC(=O)CCCNC(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C32H32N4O5/c37-29(14-7-19-33-32(41)36-27-13-6-11-24-10-4-5-12-26(24)27)34-21-30(38)35-28(20-31(39)40)25-17-15-23(16-18-25)22-8-2-1-3-9-22/h1-6,8-13,15-18,28H,7,14,19-21H2,(H,34,37)(H,35,38)(H,39,40)(H2,33,36,41)