ethyl (2S)-2-azanyl-3-[4-[1-(phenylsulfonyl)indol-3-yl]phenyl]propanoate

Systemtic Name: ethyl (2S)-2-azanyl-3-[4-[1-(phenylsulfonyl)indol-3-yl]phenyl]propanoate Openeye Name: ethyl (2S)-2-amino-3-[4-[1-(benzenesulfonyl)indol-3-yl]phenyl]propanoate CAS Name: (2S)-2-amino-3-[4-[1-(benzenesulfonyl)-3-indolyl]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-amino-3-[4-[1-(benzenesulfonyl)indol-3-yl]phenyl]propanoate Traditional Name: (2S)-2-amino-3-[4-(1-besylindol-3-yl)phenyl]propionic acid ethyl ester Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)C2=CN(C3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4)N

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC=C(C=C1)C2=CN(C3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4)N

InChI

InChI=1S/C25H24N2O4S/c1-2-31-25(28)23(26)16-18-12-14-19(15-13-18)22-17-27(24-11-7-6-10-21(22)24)32(29,30)20-8-4-3-5-9-20/h3-15,17,23H,2,16,26H2,1H3/t23-/m0/s1