N-[2-(5-methyl-2-propan-2-yl-phenoxy)ethyl]-2-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethoxy]benzamide

Systemtic Name: N-[2-(5-methyl-2-propan-2-yl-phenoxy)ethyl]-2-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethoxy]benzamide Openeye Name: N-[2-(2-isopropyl-5-methyl-phenoxy)ethyl]-2-[2-(3-nitroanilino)-2-oxo-ethoxy]benzamide CAS Name: N-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]-2-[2-(3-nitroanilino)-2-oxoethoxy]benzamide IUPAC Name: N-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]-2-[2-(3-nitroanilino)-2-oxoethoxy]benzamide Traditional Name: N-[2-(2-isopropyl-5-methyl-phenoxy)ethyl]-2-[2-keto-2-(3-nitroanilino)ethoxy]benzamide Formula: C27H29N3O6 MolecularWeight: 491.53566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCCNC(=O)C2=CC=CC=C2OCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCCNC(=O)C2=CC=CC=C2OCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C27H29N3O6/c1-18(2)22-12-11-19(3)15-25(22)35-14-13-28-27(32)23-9-4-5-10-24(23)36-17-26(31)29-20-7-6-8-21(16-20)30(33)34/h4-12,15-16,18H,13-14,17H2,1-3H3,(H,28,32)(H,29,31)