tert-butyl 4-[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]piperidine-1-carboxylate CAS Name: 4-[6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]-4-quinazolinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]piperidine-1-carboxylate Traditional Name: 4-[6-methoxy-7-[3-(4-methylpiperazino)propoxy]quinazolin-4-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C27H41N5O4 MolecularWeight: 499.64554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC=NC3=CC(=C(C=C32)OC)OCCCN4CCN(CC4)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC=NC3=CC(=C(C=C32)OC)OCCCN4CCN(CC4)C

InChI

InChI=1S/C27H41N5O4/c1-27(2,3)36-26(33)32-10-7-20(8-11-32)25-21-17-23(34-5)24(18-22(21)28-19-29-25)35-16-6-9-31-14-12-30(4)13-15-31/h17-20H,6-16H2,1-5H3