4-azanyl-2-[2-[(2-chlorophenyl)methyl]pentanoyl]-3-nitro-benzoic acid

Systemtic Name: 4-azanyl-2-[2-[(2-chlorophenyl)methyl]pentanoyl]-3-nitro-benzoic acid Openeye Name: 4-amino-2-[2-[(2-chlorophenyl)methyl]pentanoyl]-3-nitro-benzoic acid CAS Name: 4-amino-2-[2-[(2-chlorophenyl)methyl]-1-oxopentyl]-3-nitrobenzoic acid IUPAC Name: 4-amino-2-[2-[(2-chlorophenyl)methyl]pentanoyl]-3-nitrobenzoic acid Traditional Name: 4-amino-2-[2-(2-chlorobenzyl)pentanoyl]-3-nitro-benzoic acid Formula: C19H19ClN2O5 MolecularWeight: 390.81756

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC=CC=C1Cl)C(=O)C2=C(C=CC(=C2[N+](=O)[O-])N)C(=O)O

Isomeric SMILES

CCCC(CC1=CC=CC=C1Cl)C(=O)C2=C(C=CC(=C2[N+](=O)[O-])N)C(=O)O

InChI

InChI=1S/C19H19ClN2O5/c1-2-5-12(10-11-6-3-4-7-14(11)20)18(23)16-13(19(24)25)8-9-15(21)17(16)22(26)27/h3-4,6-9,12H,2,5,10,21H2,1H3,(H,24,25)