1-[4-[(1S,3S)-3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]phenyl]carbonylazetidine-3-carboxylic acid

Systemtic Name: 1-[4-[(1S,3S)-3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]phenyl]carbonylazetidine-3-carboxylic acid Openeye Name: 1-[4-[(1S,3S)-3-[[(1R)-1-(1-naphthyl)ethyl]amino]cyclohexyl]benzoyl]azetidine-3-carboxylic acid CAS Name: 1-[[4-[(1S,3S)-3-[[(1R)-1-(1-naphthalenyl)ethyl]amino]cyclohexyl]phenyl]-oxomethyl]-3-azetidinecarboxylic acid IUPAC Name: 1-[4-[(1S,3S)-3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzoyl]azetidine-3-carboxylic acid Traditional Name: 1-[4-[(1S,3S)-3-[[(1R)-1-(1-naphthyl)ethyl]amino]cyclohexyl]benzoyl]azetidine-3-carboxylic acid Formula: C29H32N2O3 MolecularWeight: 456.57598

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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)N5CC(C5)C(=O)O

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)N5CC(C5)C(=O)O

InChI

InChI=1S/C29H32N2O3/c1-19(26-11-5-7-21-6-2-3-10-27(21)26)30-25-9-4-8-23(16-25)20-12-14-22(15-13-20)28(32)31-17-24(18-31)29(33)34/h2-3,5-7,10-15,19,23-25,30H,4,8-9,16-18H2,1H3,(H,33,34)/t19-,23+,25+/m1/s1