[4-[(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methoxy]-3-methoxy-phenyl]methyl-propan-2-yl-azanium

Systemtic Name: [4-[(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)methoxy]-3-methoxy-phenyl]methyl-propan-2-yl-azanium Openeye Name: [4-[(1,3-dimethyl-2-oxo-benzimidazol-5-yl)methoxy]-3-methoxy-phenyl]methyl-isopropyl-ammonium CAS Name: [4-[(1,3-dimethyl-2-oxo-5-benzimidazolyl)methoxy]-3-methoxyphenyl]methyl-propan-2-ylammonium IUPAC Name: [4-[(1,3-dimethyl-2-oxobenzimidazol-5-yl)methoxy]-3-methoxyphenyl]methyl-propan-2-ylazanium Traditional Name: isopropyl-[4-[(2-keto-1,3-dimethyl-benzimidazol-5-yl)methoxy]-3-methoxy-benzyl]ammonium Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]CC1=CC(=C(C=C1)OCC2=CC3=C(C=C2)N(C(=O)N3C)C)OC

Isomeric SMILES

CC(C)[NH2+]CC1=CC(=C(C=C1)OCC2=CC3=C(C=C2)N(C(=O)N3C)C)OC

InChI

InChI=1S/C21H27N3O3/c1-14(2)22-12-15-7-9-19(20(11-15)26-5)27-13-16-6-8-17-18(10-16)24(4)21(25)23(17)3/h6-11,14,22H,12-13H2,1-5H3/p+1