1-[7-(4-nitrophenyl)-2-propan-2-yl-heptanoyl]pyrrolidine-2-carbaldehyde

Systemtic Name: 1-[7-(4-nitrophenyl)-2-propan-2-yl-heptanoyl]pyrrolidine-2-carbaldehyde Openeye Name: 1-[2-isopropyl-7-(4-nitrophenyl)heptanoyl]pyrrolidine-2-carbaldehyde CAS Name: 1-[7-(4-nitrophenyl)-1-oxo-2-propan-2-ylheptyl]-2-pyrrolidinecarboxaldehyde IUPAC Name: 1-[7-(4-nitrophenyl)-2-propan-2-ylheptanoyl]pyrrolidine-2-carbaldehyde Traditional Name: 1-[2-isopropyl-7-(4-nitrophenyl)heptanoyl]pyrrolidine-2-carbaldehyde Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCCCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)N2CCCC2C=O

Isomeric SMILES

CC(C)C(CCCCCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)N2CCCC2C=O

InChI

InChI=1S/C21H30N2O4/c1-16(2)20(21(25)22-14-6-8-19(22)15-24)9-5-3-4-7-17-10-12-18(13-11-17)23(26)27/h10-13,15-16,19-20H,3-9,14H2,1-2H3