[3-[(4-aminophenyl)-ethyl-amino]-3-oxidanylidene-propyl]-ethyl-pentan-2-yl-azanium; ethane; propanamide; chloride

Systemtic Name: [3-[(4-aminophenyl)-ethyl-amino]-3-oxidanylidene-propyl]-ethyl-pentan-2-yl-azanium; ethane; propanamide; chloride Openeye Name: [3-(4-amino-N-ethyl-anilino)-3-oxo-propyl]-ethyl-(1-methylbutyl)ammonium; ethane; propanamide; chloride CAS Name: [3-(4-amino-N-ethylanilino)-3-oxopropyl]-ethyl-pentan-2-ylammonium; ethane; propanamide; chloride IUPAC Name: [3-(4-amino-N-ethylanilino)-3-oxopropyl]-ethyl-pentan-2-ylazanium; ethane; propanamide; chloride Traditional Name: [3-(4-amino-N-ethyl-anilino)-3-keto-propyl]-ethyl-(1-methylbutyl)ammonium; ethane; propionamide; chloride Formula: C23H45ClN4O2 MolecularWeight: 445.082

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Descriptors Computed from Structure

Canonical SMILES:

CC.CCCC(C)[NH+](CC)CCC(=O)N(CC)C1=CC=C(C=C1)N.CCC(=O)N.[Cl-]

Isomeric SMILES

CC.CCCC(C)[NH+](CC)CCC(=O)N(CC)C1=CC=C(C=C1)N.CCC(=O)N.[Cl-]

InChI

InChI=1S/C18H31N3O.C3H7NO.C2H6.ClH/c1-5-8-15(4)20(6-2)14-13-18(22)21(7-3)17-11-9-16(19)10-12-17;1-2-3(4)5;1-2;/h9-12,15H,5-8,13-14,19H2,1-4H3;2H2,1H3,(H2,4,5);1-2H3;1H