(4S)-6-chloranyl-4-phenyl-2-pyrrolidin-1-ium-1-ylidene-3,4-dihydro-1H-quinazoline

Systemtic Name: (4S)-6-chloranyl-4-phenyl-2-pyrrolidin-1-ium-1-ylidene-3,4-dihydro-1H-quinazoline Openeye Name: (4S)-6-chloro-4-phenyl-2-pyrrolidin-1-ium-1-ylidene-3,4-dihydro-1H-quinazoline CAS Name: (4S)-6-chloro-4-phenyl-2-(1-pyrrolidin-1-iumylidene)-3,4-dihydro-1H-quinazoline IUPAC Name: (4S)-6-chloro-4-phenyl-2-pyrrolidin-1-ium-1-ylidene-3,4-dihydro-1H-quinazoline Traditional Name: (4S)-6-chloro-4-phenyl-2-pyrrolidin-1-ium-1-ylidene-3,4-dihydro-1H-quinazoline Formula: C18H19ClN3+ MolecularWeight: 312.81656

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](=C2NC(C3=C(N2)C=CC(=C3)Cl)C4=CC=CC=C4)C1

Isomeric SMILES

C1CC[N+](=C2N[C@H](C3=C(N2)C=CC(=C3)Cl)C4=CC=CC=C4)C1

InChI

InChI=1S/C18H18ClN3/c19-14-8-9-16-15(12-14)17(13-6-2-1-3-7-13)21-18(20-16)22-10-4-5-11-22/h1-3,6-9,12,17H,4-5,10-11H2,(H,20,21)/p+1/t17-/m0/s1