(2-methoxy-4-nitro-phenyl)methyl N-[2-[(9-azanyl-5-methyl-acridin-4-yl)carbonylamino]ethyl]-N-methyl-carbamate

Systemtic Name: (2-methoxy-4-nitro-phenyl)methyl N-[2-[(9-azanyl-5-methyl-acridin-4-yl)carbonylamino]ethyl]-N-methyl-carbamate Openeye Name: (2-methoxy-4-nitro-phenyl)methyl N-[2-[(9-amino-5-methyl-acridine-4-carbonyl)amino]ethyl]-N-methyl-carbamate CAS Name: N-[2-[[(9-amino-5-methyl-4-acridinyl)-oxomethyl]amino]ethyl]-N-methylcarbamic acid (2-methoxy-4-nitrophenyl)methyl ester IUPAC Name: (2-methoxy-4-nitrophenyl)methyl N-[2-[(9-amino-5-methylacridine-4-carbonyl)amino]ethyl]-N-methylcarbamate Traditional Name: N-[2-[(9-amino-5-methyl-acridine-4-carbonyl)amino]ethyl]-N-methyl-carbamic acid (2-methoxy-4-nitro-benzyl) ester Formula: C27H27N5O6 MolecularWeight: 517.53318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C(C3=C(C(=CC=C3)C(=O)NCCN(C)C(=O)OCC4=C(C=C(C=C4)[N+](=O)[O-])OC)N=C12)N

Isomeric SMILES

CC1=CC=CC2=C(C3=C(C(=CC=C3)C(=O)NCCN(C)C(=O)OCC4=C(C=C(C=C4)[N+](=O)[O-])OC)N=C12)N

InChI

InChI=1S/C27H27N5O6/c1-16-6-4-7-19-23(28)20-8-5-9-21(25(20)30-24(16)19)26(33)29-12-13-31(2)27(34)38-15-17-10-11-18(32(35)36)14-22(17)37-3/h4-11,14H,12-13,15H2,1-3H3,(H2,28,30)(H,29,33)