ethyl 2-[[5-chloranyl-4-[5-(dimethylamino)pentyl]-2-oxidanyl-phenyl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[[5-chloranyl-4-[5-(dimethylamino)pentyl]-2-oxidanyl-phenyl]carbonylamino]-3-phenyl-propanoate Openeye Name: ethyl 2-[[5-chloro-4-[5-(dimethylamino)pentyl]-2-hydroxy-benzoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[5-chloro-4-[5-(dimethylamino)pentyl]-2-hydroxyphenyl]-oxomethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[[5-chloro-4-[5-(dimethylamino)pentyl]-2-hydroxybenzoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[5-chloro-4-[5-(dimethylamino)pentyl]-2-hydroxy-benzoyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C25H33ClN2O4 MolecularWeight: 460.99352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2O)CCCCCN(C)C)Cl

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2O)CCCCCN(C)C)Cl

InChI

InChI=1S/C25H33ClN2O4/c1-4-32-25(31)22(15-18-11-7-5-8-12-18)27-24(30)20-17-21(26)19(16-23(20)29)13-9-6-10-14-28(2)3/h5,7-8,11-12,16-17,22,29H,4,6,9-10,13-15H2,1-3H3,(H,27,30)