2-[2-[[(E)-3-(4-methylphenyl)-6-naphthalen-2-yl-hex-5-en-2-yl]-(naphthalen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]butanedioic acid

Systemtic Name: 2-[2-[[(E)-3-(4-methylphenyl)-6-naphthalen-2-yl-hex-5-en-2-yl]-(naphthalen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]butanedioic acid Openeye Name: 2-[2-[[(E)-1-methyl-5-(2-naphthyl)-2-(p-tolyl)pent-4-enyl]-(2-naphthylmethyl)amino]-2-oxo-ethyl]butanedioic acid CAS Name: 2-[2-[[(E)-3-(4-methylphenyl)-6-(2-naphthalenyl)hex-5-en-2-yl]-(2-naphthalenylmethyl)amino]-2-oxoethyl]butanedioic acid IUPAC Name: 2-[2-[[(E)-3-(4-methylphenyl)-6-naphthalen-2-ylhex-5-en-2-yl]-(naphthalen-2-ylmethyl)amino]-2-oxoethyl]butanedioic acid Traditional Name: 2-[2-keto-2-[[(E)-1-methyl-5-(2-naphthyl)-2-(p-tolyl)pent-4-enyl]-(2-naphthylmethyl)amino]ethyl]succinic acid Formula: C40H39NO5 MolecularWeight: 613.74136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC=CC2=CC3=CC=CC=C3C=C2)C(C)N(CC4=CC5=CC=CC=C5C=C4)C(=O)CC(CC(=O)O)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(C/C=C/C2=CC3=CC=CC=C3C=C2)C(C)N(CC4=CC5=CC=CC=C5C=C4)C(=O)CC(CC(=O)O)C(=O)O

InChI

InChI=1S/C40H39NO5/c1-27-14-18-33(19-15-27)37(13-7-8-29-16-20-31-9-3-5-11-34(31)22-29)28(2)41(38(42)24-36(40(45)46)25-39(43)44)26-30-17-21-32-10-4-6-12-35(32)23-30/h3-12,14-23,28,36-37H,13,24-26H2,1-2H3,(H,43,44)(H,45,46)/b8-7+