tert-butyl N-[5-[2-[(3-methoxy-4-nitro-phenyl)carbonyl-methyl-amino]-5-methyl-phenoxy]pentyl]carbamate

Systemtic Name: tert-butyl N-[5-[2-[(3-methoxy-4-nitro-phenyl)carbonyl-methyl-amino]-5-methyl-phenoxy]pentyl]carbamate Openeye Name: tert-butyl N-[5-[2-[(3-methoxy-4-nitro-benzoyl)-methyl-amino]-5-methyl-phenoxy]pentyl]carbamate CAS Name: N-[5-[2-[[(3-methoxy-4-nitrophenyl)-oxomethyl]-methylamino]-5-methylphenoxy]pentyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-[2-[(3-methoxy-4-nitrobenzoyl)-methylamino]-5-methylphenoxy]pentyl]carbamate Traditional Name: N-[5-[2-[(3-methoxy-4-nitro-benzoyl)-methyl-amino]-5-methyl-phenoxy]pentyl]carbamic acid tert-butyl ester Formula: C26H35N3O7 MolecularWeight: 501.572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])OC)OCCCCCNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])OC)OCCCCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C26H35N3O7/c1-18-10-12-20(28(5)24(30)19-11-13-21(29(32)33)22(17-19)34-6)23(16-18)35-15-9-7-8-14-27-25(31)36-26(2,3)4/h10-13,16-17H,7-9,14-15H2,1-6H3,(H,27,31)