2-[2-[[(E)-3-(4-chlorophenyl)-8-naphthalen-2-yl-oct-7-en-2-yl]-(naphthalen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]butanedioic acid

Systemtic Name: 2-[2-[[(E)-3-(4-chlorophenyl)-8-naphthalen-2-yl-oct-7-en-2-yl]-(naphthalen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]butanedioic acid Openeye Name: 2-[2-[[(E)-2-(4-chlorophenyl)-1-methyl-7-(2-naphthyl)hept-6-enyl]-(2-naphthylmethyl)amino]-2-oxo-ethyl]butanedioic acid CAS Name: 2-[2-[[(E)-3-(4-chlorophenyl)-8-(2-naphthalenyl)oct-7-en-2-yl]-(2-naphthalenylmethyl)amino]-2-oxoethyl]butanedioic acid IUPAC Name: 2-[2-[[(E)-3-(4-chlorophenyl)-8-naphthalen-2-yloct-7-en-2-yl]-(naphthalen-2-ylmethyl)amino]-2-oxoethyl]butanedioic acid Traditional Name: 2-[2-[[(E)-2-(4-chlorophenyl)-1-methyl-7-(2-naphthyl)hept-6-enyl]-(2-naphthylmethyl)amino]-2-keto-ethyl]succinic acid Formula: C41H40ClNO5 MolecularWeight: 662.213

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCCC=CC1=CC2=CC=CC=C2C=C1)C3=CC=C(C=C3)Cl)N(CC4=CC5=CC=CC=C5C=C4)C(=O)CC(CC(=O)O)C(=O)O

Isomeric SMILES

CC(C(CCC/C=C/C1=CC2=CC=CC=C2C=C1)C3=CC=C(C=C3)Cl)N(CC4=CC5=CC=CC=C5C=C4)C(=O)CC(CC(=O)O)C(=O)O

InChI

InChI=1S/C41H40ClNO5/c1-28(43(39(44)25-36(41(47)48)26-40(45)46)27-30-16-18-32-11-6-8-13-35(32)24-30)38(33-19-21-37(42)22-20-33)14-4-2-3-9-29-15-17-31-10-5-7-12-34(31)23-29/h3,5-13,15-24,28,36,38H,2,4,14,25-27H2,1H3,(H,45,46)(H,47,48)/b9-3+