tert-butyl N-[3-[4-[4-(3-methylphenyl)piperazin-1-yl]butylcarbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[3-[4-[4-(3-methylphenyl)piperazin-1-yl]butylcarbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[3-[4-[4-(m-tolyl)piperazin-1-yl]butylcarbamoyl]phenyl]carbamate CAS Name: N-[3-[[4-[4-(3-methylphenyl)-1-piperazinyl]butylamino]-oxomethyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[4-[4-(3-methylphenyl)piperazin-1-yl]butylcarbamoyl]phenyl]carbamate Traditional Name: N-[3-[4-[4-(m-tolyl)piperazino]butylcarbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C27H38N4O3 MolecularWeight: 466.61562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNC(=O)C3=CC(=CC=C3)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNC(=O)C3=CC(=CC=C3)NC(=O)OC(C)(C)C

InChI

InChI=1S/C27H38N4O3/c1-21-9-7-12-24(19-21)31-17-15-30(16-18-31)14-6-5-13-28-25(32)22-10-8-11-23(20-22)29-26(33)34-27(2,3)4/h7-12,19-20H,5-6,13-18H2,1-4H3,(H,28,32)(H,29,33)