(4-bromophenyl)methyl-[3-[4-(3-methylphenyl)piperidin-1-yl]carbonylphenyl]carbamic acid

Systemtic Name: (4-bromophenyl)methyl-[3-[4-(3-methylphenyl)piperidin-1-yl]carbonylphenyl]carbamic acid Openeye Name: (4-bromophenyl)methyl-[3-[4-(m-tolyl)piperidine-1-carbonyl]phenyl]carbamic acid CAS Name: (4-bromophenyl)methyl-[3-[[4-(3-methylphenyl)-1-piperidinyl]-oxomethyl]phenyl]carbamic acid IUPAC Name: (4-bromophenyl)methyl-[3-[4-(3-methylphenyl)piperidine-1-carbonyl]phenyl]carbamic acid Traditional Name: (4-bromobenzyl)-[3-[4-(m-tolyl)piperidine-1-carbonyl]phenyl]carbamic acid Formula: C27H27BrN2O3 MolecularWeight: 507.41888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CCN(CC2)C(=O)C3=CC(=CC=C3)N(CC4=CC=C(C=C4)Br)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C2CCN(CC2)C(=O)C3=CC(=CC=C3)N(CC4=CC=C(C=C4)Br)C(=O)O

InChI

InChI=1S/C27H27BrN2O3/c1-19-4-2-5-22(16-19)21-12-14-29(15-13-21)26(31)23-6-3-7-25(17-23)30(27(32)33)18-20-8-10-24(28)11-9-20/h2-11,16-17,21H,12-15,18H2,1H3,(H,32,33)