1-(3-methyl-5-nitro-7-phenylmethoxy-3a,7a-dihydroindol-1-yl)ethanone

Systemtic Name: 1-(3-methyl-5-nitro-7-phenylmethoxy-3a,7a-dihydroindol-1-yl)ethanone Openeye Name: 1-(7-benzyloxy-3-methyl-5-nitro-3a,7a-dihydroindol-1-yl)ethanone CAS Name: 1-(3-methyl-5-nitro-7-phenylmethoxy-3a,7a-dihydroindol-1-yl)ethanone IUPAC Name: 1-(3-methyl-5-nitro-7-phenylmethoxy-3a,7a-dihydroindol-1-yl)ethanone Traditional Name: 1-(7-benzoxy-3-methyl-5-nitro-3a,7a-dihydroindol-1-yl)ethanone Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2C1C=C(C=C2OCC3=CC=CC=C3)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=CN(C2C1C=C(C=C2OCC3=CC=CC=C3)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C18H18N2O4/c1-12-10-19(13(2)21)18-16(12)8-15(20(22)23)9-17(18)24-11-14-6-4-3-5-7-14/h3-10,16,18H,11H2,1-2H3