2-[cyclohexyl-[4-[(1S,3S)-3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]phenyl]carbonyl-amino]ethanoic acid

Systemtic Name: 2-[cyclohexyl-[4-[(1S,3S)-3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]phenyl]carbonyl-amino]ethanoic acid Openeye Name: 2-[cyclohexyl-[4-[(1S,3S)-3-[[(1R)-1-(1-naphthyl)ethyl]amino]cyclohexyl]benzoyl]amino]acetic acid CAS Name: 2-[cyclohexyl-[[4-[(1S,3S)-3-[[(1R)-1-(1-naphthalenyl)ethyl]amino]cyclohexyl]phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[cyclohexyl-[4-[(1S,3S)-3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzoyl]amino]acetic acid Traditional Name: 2-[cyclohexyl-[4-[(1S,3S)-3-[[(1R)-1-(1-naphthyl)ethyl]amino]cyclohexyl]benzoyl]amino]acetic acid Formula: C33H40N2O3 MolecularWeight: 512.6823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC3CCCC(C3)C4=CC=C(C=C4)C(=O)N(CC(=O)O)C5CCCCC5

Isomeric SMILES

C[C@H](C1=CC=CC2=CC=CC=C21)N[C@H]3CCC[C@@H](C3)C4=CC=C(C=C4)C(=O)N(CC(=O)O)C5CCCCC5

InChI

InChI=1S/C33H40N2O3/c1-23(30-16-8-10-25-9-5-6-15-31(25)30)34-28-12-7-11-27(21-28)24-17-19-26(20-18-24)33(38)35(22-32(36)37)29-13-3-2-4-14-29/h5-6,8-10,15-20,23,27-29,34H,2-4,7,11-14,21-22H2,1H3,(H,36,37)/t23-,27+,28+/m1/s1