1-[[4-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]carbonylphenyl]methyl]-3-propan-2-yl-urea

Systemtic Name: 1-[[4-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]carbonylphenyl]methyl]-3-propan-2-yl-urea Openeye Name: 1-isopropyl-3-[[4-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]phenyl]methyl]urea CAS Name: 1-[[4-[[4-[(4-methoxyphenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]phenyl]methyl]-3-propan-2-ylurea IUPAC Name: 1-[[4-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]phenyl]methyl]-3-propan-2-ylurea Traditional Name: 1-isopropyl-3-[4-(4-p-anisylpiperazin-4-ium-1-carbonyl)benzyl]urea Formula: C24H33N4O3+ MolecularWeight: 425.54382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C24H32N4O3/c1-18(2)26-24(30)25-16-19-4-8-21(9-5-19)23(29)28-14-12-27(13-15-28)17-20-6-10-22(31-3)11-7-20/h4-11,18H,12-17H2,1-3H3,(H2,25,26,30)/p+1