N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-morpholin-4-ylsulfonyl-4-nitro-aniline

Systemtic Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-morpholin-4-ylsulfonyl-4-nitro-aniline Openeye Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-morpholinosulfonyl-4-nitro-aniline CAS Name: N-[2-(4-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-2-(4-morpholinylsulfonyl)-4-nitroaniline IUPAC Name: N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2-morpholin-4-ylsulfonyl-4-nitroaniline Traditional Name: [2-(4-methoxyphenyl)-2-pyrrolidino-ethyl]-(2-morpholinosulfonyl-4-nitro-phenyl)amine Formula: C23H30N4O6S MolecularWeight: 490.5725

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)N4CCCC4

InChI

InChI=1S/C23H30N4O6S/c1-32-20-7-4-18(5-8-20)22(25-10-2-3-11-25)17-24-21-9-6-19(27(28)29)16-23(21)34(30,31)26-12-14-33-15-13-26/h4-9,16,22,24H,2-3,10-15,17H2,1H3