N-bis(2-ethylpiperidin-1-yl)phosphoryl-3-(4-chloranyl-3-nitro-phenyl)carbonyl-2-methyl-indolizine-1-carboxamide

Systemtic Name: N-bis(2-ethylpiperidin-1-yl)phosphoryl-3-(4-chloranyl-3-nitro-phenyl)carbonyl-2-methyl-indolizine-1-carboxamide Openeye Name: N-[bis(2-ethyl-1-piperidyl)phosphoryl]-3-(4-chloro-3-nitro-benzoyl)-2-methyl-indolizine-1-carboxamide CAS Name: N-[bis(2-ethyl-1-piperidinyl)phosphoryl]-3-[(4-chloro-3-nitrophenyl)-oxomethyl]-2-methyl-1-indolizinecarboxamide IUPAC Name: N-bis(2-ethylpiperidin-1-yl)phosphoryl-3-(4-chloro-3-nitrobenzoyl)-2-methylindolizine-1-carboxamide Traditional Name: N-bis(2-ethylpiperidino)phosphoryl-3-(4-chloro-3-nitro-benzoyl)-2-methyl-indolizine-1-carboxamide Formula: C31H39ClN5O5P MolecularWeight: 628.098621

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1P(=O)(NC(=O)C2=C3C=CC=CN3C(=C2C)C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])N5CCCCC5CC

Isomeric SMILES

CCC1CCCCN1P(=O)(NC(=O)C2=C3C=CC=CN3C(=C2C)C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])N5CCCCC5CC

InChI

InChI=1S/C31H39ClN5O5P/c1-4-23-12-6-10-18-35(23)43(42,36-19-11-7-13-24(36)5-2)33-31(39)28-21(3)29(34-17-9-8-14-26(28)34)30(38)22-15-16-25(32)27(20-22)37(40)41/h8-9,14-17,20,23-24H,4-7,10-13,18-19H2,1-3H3,(H,33,39,42)