N-[1-(4-methylphenyl)-2-morpholin-4-yl-ethyl]-3-(6-nitroindazol-1-yl)propanamide

Systemtic Name: N-[1-(4-methylphenyl)-2-morpholin-4-yl-ethyl]-3-(6-nitroindazol-1-yl)propanamide Openeye Name: N-[2-morpholino-1-(p-tolyl)ethyl]-3-(6-nitroindazol-1-yl)propanamide CAS Name: N-[1-(4-methylphenyl)-2-(4-morpholinyl)ethyl]-3-(6-nitro-1-indazolyl)propanamide IUPAC Name: N-[1-(4-methylphenyl)-2-morpholin-4-ylethyl]-3-(6-nitroindazol-1-yl)propanamide Traditional Name: N-[2-morpholino-1-(p-tolyl)ethyl]-3-(6-nitroindazol-1-yl)propionamide Formula: C23H27N5O4 MolecularWeight: 437.49158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CN2CCOCC2)NC(=O)CCN3C4=C(C=CC(=C4)[N+](=O)[O-])C=N3

Isomeric SMILES

CC1=CC=C(C=C1)C(CN2CCOCC2)NC(=O)CCN3C4=C(C=CC(=C4)[N+](=O)[O-])C=N3

InChI

InChI=1S/C23H27N5O4/c1-17-2-4-18(5-3-17)21(16-26-10-12-32-13-11-26)25-23(29)8-9-27-22-14-20(28(30)31)7-6-19(22)15-24-27/h2-7,14-15,21H,8-13,16H2,1H3,(H,25,29)