N-(2-dimethylaminoethyl)-2-[[2-hydroxyethyl(3-methylbutyl)carbamoyl]amino]-3-(4-nitrophenyl)propanamide

Systemtic Name: N-(2-dimethylaminoethyl)-2-[[2-hydroxyethyl(3-methylbutyl)carbamoyl]amino]-3-(4-nitrophenyl)propanamide Openeye Name: N-(2-dimethylaminoethyl)-2-[[2-hydroxyethyl(isopentyl)carbamoyl]amino]-3-(4-nitrophenyl)propanamide CAS Name: N-(2-dimethylaminoethyl)-2-[[[2-hydroxyethyl(3-methylbutyl)amino]-oxomethyl]amino]-3-(4-nitrophenyl)propanamide IUPAC Name: N-(2-dimethylaminoethyl)-2-[[2-hydroxyethyl(3-methylbutyl)carbamoyl]amino]-3-(4-nitrophenyl)propanamide Traditional Name: N-(2-dimethylaminoethyl)-2-[[2-hydroxyethyl(isoamyl)carbamoyl]amino]-3-(4-nitrophenyl)propionamide Formula: C21H35N5O5 MolecularWeight: 437.5331

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CCO)C(=O)NC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)NCCN(C)C

Isomeric SMILES

CC(C)CCN(CCO)C(=O)NC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)NCCN(C)C

InChI

InChI=1S/C21H35N5O5/c1-16(2)9-11-25(13-14-27)21(29)23-19(20(28)22-10-12-24(3)4)15-17-5-7-18(8-6-17)26(30)31/h5-8,16,19,27H,9-15H2,1-4H3,(H,22,28)(H,23,29)