[2-[(4-dimethylaminophenyl)carbonylamino]-4-methyl-pentanoyl]-oxidanylidene-(3-phenoxypropyl)azanium

Systemtic Name: [2-[(4-dimethylaminophenyl)carbonylamino]-4-methyl-pentanoyl]-oxidanylidene-(3-phenoxypropyl)azanium Openeye Name: [2-[[4-(dimethylamino)benzoyl]amino]-4-methyl-pentanoyl]-oxo-(3-phenoxypropyl)ammonium CAS Name: [2-[[(4-dimethylaminophenyl)-oxomethyl]amino]-4-methyl-1-oxopentyl]-oxo-(3-phenoxypropyl)ammonium IUPAC Name: [2-[[4-(dimethylamino)benzoyl]amino]-4-methylpentanoyl]-oxo-(3-phenoxypropyl)azanium Traditional Name: [2-[[4-(dimethylamino)benzoyl]amino]-4-methyl-pentanoyl]-keto-(3-phenoxypropyl)ammonium Formula: C24H32N3O4+ MolecularWeight: 426.52858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[N+](=O)CCCOC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC(C)CC(C(=O)[N+](=O)CCCOC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C24H31N3O4/c1-18(2)17-22(25-23(28)19-11-13-20(14-12-19)26(3)4)24(29)27(30)15-8-16-31-21-9-6-5-7-10-21/h5-7,9-14,18,22H,8,15-17H2,1-4H3/p+1