2-[(4-methyl-3-pyrrol-1-yl-phenyl)carbonylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[(4-methyl-3-pyrrol-1-yl-phenyl)carbonylamino]ethyl-di(propan-2-yl)azanium Openeye Name: diisopropyl-[2-[(4-methyl-3-pyrrol-1-yl-benzoyl)amino]ethyl]ammonium CAS Name: 2-[[[4-methyl-3-(1-pyrrolyl)phenyl]-oxomethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[(4-methyl-3-pyrrol-1-ylbenzoyl)amino]ethyl-di(propan-2-yl)azanium Traditional Name: diisopropyl-[2-[(4-methyl-3-pyrrol-1-yl-benzoyl)amino]ethyl]ammonium Formula: C20H30N3O+ MolecularWeight: 328.4717

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC[NH+](C(C)C)C(C)C)N2C=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC[NH+](C(C)C)C(C)C)N2C=CC=C2

InChI

InChI=1S/C20H29N3O/c1-15(2)23(16(3)4)13-10-21-20(24)18-9-8-17(5)19(14-18)22-11-6-7-12-22/h6-9,11-12,14-16H,10,13H2,1-5H3,(H,21,24)/p+1