3-[(4-methyl-1-nitro-acridin-9-yl)amino]propyl propanoate hydrochloride

Systemtic Name: 3-[(4-methyl-1-nitro-acridin-9-yl)amino]propyl propanoate hydrochloride Openeye Name: 3-[(4-methyl-1-nitro-acridin-9-yl)amino]propyl propanoate hydrochloride CAS Name: propanoic acid 3-[(4-methyl-1-nitro-9-acridinyl)amino]propyl ester hydrochloride IUPAC Name: 3-[(4-methyl-1-nitroacridin-9-yl)amino]propyl propanoate hydrochloride Traditional Name: propionic acid 3-[(4-methyl-1-nitro-acridin-9-yl)amino]propyl ester hydrochloride Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCCCNC1=C2C(=CC=C(C2=NC3=CC=CC=C31)C)[N+](=O)[O-].Cl

Isomeric SMILES

CCC(=O)OCCCNC1=C2C(=CC=C(C2=NC3=CC=CC=C31)C)[N+](=O)[O-].Cl

InChI

InChI=1S/C20H21N3O4.ClH/c1-3-17(24)27-12-6-11-21-20-14-7-4-5-8-15(14)22-19-13(2)9-10-16(18(19)20)23(25)26;/h4-5,7-10H,3,6,11-12H2,1-2H3,(H,21,22);1H