2-[bis[2-[methyl-(2-methyl-1-phenyl-propan-2-yl)amino]-2-oxidanylidene-ethyl]amino]ethyl 4-nitrobenzoate

Systemtic Name: 2-[bis[2-[methyl-(2-methyl-1-phenyl-propan-2-yl)amino]-2-oxidanylidene-ethyl]amino]ethyl 4-nitrobenzoate Openeye Name: 2-[bis[2-[(1,1-dimethyl-2-phenyl-ethyl)-methyl-amino]-2-oxo-ethyl]amino]ethyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 2-[bis[2-[methyl-(2-methyl-1-phenylpropan-2-yl)amino]-2-oxoethyl]amino]ethyl ester IUPAC Name: 2-[bis[2-[methyl-(2-methyl-1-phenylpropan-2-yl)amino]-2-oxoethyl]amino]ethyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 2-[bis[2-[(1,1-dimethyl-2-phenyl-ethyl)-methyl-amino]-2-keto-ethyl]amino]ethyl ester Formula: C35H44N4O6 MolecularWeight: 616.74706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=CC=C1)N(C)C(=O)CN(CCOC(=O)C2=CC=C(C=C2)[N+](=O)[O-])CC(=O)N(C)C(C)(C)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(CC1=CC=CC=C1)N(C)C(=O)CN(CCOC(=O)C2=CC=C(C=C2)[N+](=O)[O-])CC(=O)N(C)C(C)(C)CC3=CC=CC=C3

InChI

InChI=1S/C35H44N4O6/c1-34(2,23-27-13-9-7-10-14-27)36(5)31(40)25-38(21-22-45-33(42)29-17-19-30(20-18-29)39(43)44)26-32(41)37(6)35(3,4)24-28-15-11-8-12-16-28/h7-20H,21-26H2,1-6H3