tert-butyl 4-[3-methoxy-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-methoxy-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[3-methoxy-1-[4-(7-methoxy-8-quinolyl)-1,4-diazepan-1-yl]-3-oxo-propyl]piperidine-1-carboxylate CAS Name: 4-[3-methoxy-1-[4-(7-methoxy-8-quinolinyl)-1,4-diazepan-1-yl]-3-oxopropyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-methoxy-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-oxopropyl]piperidine-1-carboxylate Traditional Name: 4-[3-keto-3-methoxy-1-[4-(7-methoxy-8-quinolyl)-1,4-diazepan-1-yl]propyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C29H42N4O5 MolecularWeight: 526.66758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(CC(=O)OC)N2CCCN(CC2)C3=C(C=CC4=C3N=CC=C4)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(CC(=O)OC)N2CCCN(CC2)C3=C(C=CC4=C3N=CC=C4)OC

InChI

InChI=1S/C29H42N4O5/c1-29(2,3)38-28(35)33-16-11-21(12-17-33)23(20-25(34)37-5)31-14-7-15-32(19-18-31)27-24(36-4)10-9-22-8-6-13-30-26(22)27/h6,8-10,13,21,23H,7,11-12,14-20H2,1-5H3