2-[2-acetyloxyethyl-[9-[3-(dimethylamino)propylamino]-1-nitro-acridin-4-yl]amino]ethyl ethanoate

Systemtic Name: 2-[2-acetyloxyethyl-[9-[3-(dimethylamino)propylamino]-1-nitro-acridin-4-yl]amino]ethyl ethanoate Openeye Name: 2-[2-acetoxyethyl-[9-[3-(dimethylamino)propylamino]-1-nitro-acridin-4-yl]amino]ethyl acetate CAS Name: acetic acid 2-[2-acetyloxyethyl-[9-[3-(dimethylamino)propylamino]-1-nitro-4-acridinyl]amino]ethyl ester IUPAC Name: 2-[2-acetyloxyethyl-[9-[3-(dimethylamino)propylamino]-1-nitroacridin-4-yl]amino]ethyl acetate Traditional Name: acetic acid 2-[2-acetoxyethyl-[9-[3-(dimethylamino)propylamino]-1-nitro-acridin-4-yl]amino]ethyl ester Formula: C26H33N5O6 MolecularWeight: 511.57012

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN(CCOC(=O)C)C1=CC=C(C2=C(C3=CC=CC=C3N=C12)NCCCN(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCN(CCOC(=O)C)C1=CC=C(C2=C(C3=CC=CC=C3N=C12)NCCCN(C)C)[N+](=O)[O-]

InChI

InChI=1S/C26H33N5O6/c1-18(32)36-16-14-30(15-17-37-19(2)33)23-11-10-22(31(34)35)24-25(27-12-7-13-29(3)4)20-8-5-6-9-21(20)28-26(23)24/h5-6,8-11H,7,12-17H2,1-4H3,(H,27,28)