propan-2-yl N-[11-(4-methylpiperazin-4-ium-1-yl)carbonyl-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate

Systemtic Name: propan-2-yl N-[11-(4-methylpiperazin-4-ium-1-yl)carbonyl-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate Openeye Name: isopropyl N-[11-(4-methylpiperazin-4-ium-1-carbonyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate CAS Name: N-[11-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamic acid propan-2-yl ester IUPAC Name: propan-2-yl N-[11-(4-methylpiperazin-4-ium-1-carbonyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate Traditional Name: N-[11-(4-methylpiperazin-4-ium-1-carbonyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamic acid isopropyl ester Formula: C24H31N4O3+ MolecularWeight: 423.52794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)NC1=CC2=C(CCC3=CC=CC=C3N2C(=O)N4CC[NH+](CC4)C)C=C1

Isomeric SMILES

CC(C)OC(=O)NC1=CC2=C(CCC3=CC=CC=C3N2C(=O)N4CC[NH+](CC4)C)C=C1

InChI

InChI=1S/C24H30N4O3/c1-17(2)31-23(29)25-20-11-10-19-9-8-18-6-4-5-7-21(18)28(22(19)16-20)24(30)27-14-12-26(3)13-15-27/h4-7,10-11,16-17H,8-9,12-15H2,1-3H3,(H,25,29)/p+1